HIT ID: HIT212671649
Cas No: 1198151-75-5
分子式: C21H32N4O11P2
分子量: 578.452
常用名: Vapendavir diphosphate
氢键受体数 (HBA): 6
氢键供体数 (HBD): 0
LogP: 3.2661195
IUPAC: 3-ethoxy-6-{2-[1-(6-methylpyridazin-3-yl)piperidin-4-yl]ethoxy}-1,2-benzoxazole; bis(phosphoric acid)
IUPAC: 3-ethoxy-6-{2-[1-(6-methylpyridazin-3-yl)piperidin-4-yl]ethoxy}-1,2-benzoxazole; bis(phosphoric acid)
SMILES: OP(O)(O)=O.OP(O)(O)=O.CCOc1noc2cc(OCCC3CCN(CC3)c3ccc(C)nn3)ccc12
SMILES: OP(O)(O)=O.OP(O)(O)=O.CCOc1noc2cc(OCCC3CCN(CC3)c3ccc(C)nn3)ccc12
InChI key: MIUFDXZDQWMWRR-UHFFFAOYSA-N
